ChemSpider 2D Image | [(Bis{3-[(phosphonomethyl)amino]propyl}amino)(diphosphono)methyl]phosphonic acid | C9H28N3O15P5

[(Bis{3-[(phosphonomethyl)amino]propyl}amino)(diphosphono)methyl]phosphonic acid

  • Molecular FormulaC9H28N3O15P5
  • Average mass573.198 Da
  • Monoisotopic mass573.020874 Da
  • ChemSpider ID95501598

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[(Bis{3-[(phosphonomethyl)amino]propyl}amino)(diphosphono)methyl]phosphonic acid [ACD/IUPAC Name]
[(Bis{3-[(phosphonomethyl)amino]propyl}amino)(diphosphono)methyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(bis{3-[(phosphonométhyl)amino]propyl}amino)(diphosphono)méthyl]phosphonique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.9±0.1 g/cm3
Boiling Point: 1027.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 162.7±6.0 kJ/mol
Flash Point: 575.3±37.1 °C
Index of Refraction: 1.618
Molar Refractivity: 104.3±0.3 cm3
#H bond acceptors: 18
#H bond donors: 12
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -7.40
ACD/LogD (pH 5.5): -15.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -18.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 364 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 124.5±3.0 dyne/cm
Molar Volume: 297.8±3.0 cm3

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